(E)-3-(1,3-benzodioxol-5-yl)-N,N-bis(cyanomethyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N,N-bis(cyanomethyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N,N-bis(cyanomethyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N,N-bis(cyanomethyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N,N-bis(cyanomethyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N,N-bis(cyanomethyl)acrylamide Formula: C14H11N3O3 MolecularWeight: 269.25544

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)N(CC#N)CC#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)N(CC#N)CC#N

InChI

InChI=1S/C14H11N3O3/c15-5-7-17(8-6-16)14(18)4-2-11-1-3-12-13(9-11)20-10-19-12/h1-4,9H,7-8,10H2/b4-2+